Information card for entry 7250251

Structure parameters

• Formula: C7 H22 Cl2 Co N6 Na O5.69 S
• Calculated formula: C7 H22 Cl2 Co N6 Na O5.688 S
• Title of publication: Multi-component supramolecular compounds containing hexaamminecobalt(iii) cations and aromatic sulfonic acid derivatives
• Authors of publication: Beleaev, Ecaterina S.; Kravtsov, Victor Ch.; Chumakov, Yurii; Baca, Svetlana G.
• Journal of publication: CrystEngComm
• Year of publication: 2025
• Journal volume: 27
• Journal issue: 19
• Pages of publication: 3018 - 3031
• a: 14.489 ± 0.003 Å
• b: 6.871 ± 0.001 Å
• c: 17.692 ± 0.003 Å
• α: 90°
• β: 97.903 ± 0.017°
• γ: 90°
• Cell volume: 1744.6 ± 0.5 ų
• Cell temperature: 293 ± 2 K
• Ambient diffraction temperature: 293 ± 2 K
• Number of distinct elements: 8
• Space group number: 11
• Hermann-Mauguin space group symbol: P 1 21/m 1
• Hall space group symbol: -P 2yb
• Residual factor for all reflections: 0.1081
• Residual factor for significantly intense reflections: 0.0528
• Weighted residual factors for significantly intense reflections: 0.0847
• Weighted residual factors for all reflections included in the refinement: 0.0902
• Goodness-of-fit parameter for all reflections included in the refinement: 1.01
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: Yes
• Has Fobs: No